2-[4-[1-adamantyl(oxidanyl)amino]-3-oxidanyl-phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[4-[1-adamantyl(oxidanyl)amino]-3-oxidanyl-phenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: 2-[4-[1-adamantyl(hydroxy)amino]-3-hydroxy-phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[4-[1-adamantyl(hydroxy)amino]-3-hydroxyphenyl]-N-(2-pyridinyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[4-[1-adamantyl(hydroxy)amino]-3-hydroxyphenyl]-N-pyridin-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: 2-[4-[1-adamantyl(hydroxy)amino]-3-hydroxy-phenyl]-N-(2-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C29H29N5O3 MolecularWeight: 495.57226

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N(C4=C(C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N(C4=C(C=C(C=C4)C5=NC6=C(N5)C=C(C=C6)C(=O)NC7=CC=CC=N7)O)O

InChI

InChI=1S/C29H29N5O3/c35-25-13-20(5-7-24(25)34(37)29-14-17-9-18(15-29)11-19(10-17)16-29)27-31-22-6-4-21(12-23(22)32-27)28(36)33-26-3-1-2-8-30-26/h1-8,12-13,17-19,35,37H,9-11,14-16H2,(H,31,32)(H,30,33,36)